(Q34060880)

30 July 2017

title

Efficient substructure searching of large chemical libraries: the ABCD chemical cartridge (English)

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1

Dimitris K Agrafiotis

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author name string

Dimitris K Agrafiotis

1

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30 July 2017

Victor S Lobanov

2

1 reference

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Maxim Shemanarev

3

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Dmitrii N Rassokhin

4

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Sergei Izrailev

5

1 reference

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Edward P Jaeger

6

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Simson Alex

7

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Michael Farnum

8

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publication date

14 November 2011

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Journal of Chemical Information and Modeling

30 July 2017

published in

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volume

51

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issue

12

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30 July 2017

page(s)

3113-3130

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The Blue Obelisk-interoperability in chemical informatics

30 July 2017

cites work

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1021/CI050400B

COCI

reference URL

A Graph-Theoretic Algorithm for Matching Chemical Structures.

20 December 2021

1 reference

https://opencitations.net/index/coci/api/v1/citations/10.1021/C160016A007

COCI

reference URL

SMILES, a chemical language and information system. 1. Introduction to methodology and encoding rules

4 January 2022

1 reference

28 May 2022

https://opencitations.net/index/coci/api/v1/citations/10.1021/CI00057A005

Approaches to Measure Chemical Similarity– a Review

1 reference

https://opencitations.net/index/api/v1/citations/10.1002/QSAR.200330831

COCI

reference URL

Reoptimization of MDL keys for use in drug discovery

18 January 2024

1 reference

25 May 2024

https://opencitations.net/index/api/v1/citations/10.1021/CI010132R

Identifiers

DOI

10.1021/CI200413E

1 reference

journals/jcisd/AgrafiotisLSRIJAF11

30 July 2017

DBLP publication ID

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DBLP Dataset 2021-01-02

28 January 2021

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